SCHEMBL10239684

SCHEMBL10239684

CCn1cc(OC[C@@]2(C3C=CC=CC3)C[C@H]2C(=O)Nc2ccc(F)cn2)ccc1=O

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 13/20 0.38
HCRTR2 O43614 13/20 0.38
KCNH2 Q12809 6/20 0.38
PDF Q9HBH1 1/20 0.34
NPY5R Q15761 1/20 0.33
TYK2 P29597 1/20 0.33
CHRM3 P20309 1/20 0.32
MET P08581 1/20 0.32
CYP2C8 P10632 1/20 0.31
CYP2C19 P33261 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL10239939 0.83 HCRTR1 (0.39) HCRTR1HCRTR2KCNH2PDFNPY5R
SCHEMBL10241209 0.82 HCRTR2 (0.43) HCRTR1HCRTR2KCNH2NPY5R
SCHEMBL9950023 0.79 HCRTR2 (0.61) HCRTR1HCRTR2KCNH2CYP2C8CYP2C19
SCHEMBL10239945 0.79 HCRTR1 (0.47) HCRTR1HCRTR2KCNH2
SCHEMBL2619172 0.78 HCRTR1 (0.53) HCRTR1HCRTR2KCNH2
SCHEMBL2618520 0.78 HCRTR1 (0.64) HCRTR1HCRTR2KCNH2
SCHEMBL10266359 0.78 HCRTR1 (0.53) HCRTR1HCRTR2KCNH2
SCHEMBL2619082 0.76 HCRTR1 (0.64) HCRTR1HCRTR2KCNH2
SCHEMBL10241616 0.73 HCRTR1 (0.40) HCRTR1HCRTR2KCNH2PDFCHRM3
SCHEMBL10241215 0.72 HCRTR1 (0.38) HCRTR1HCRTR2KCNH2PDF

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120165339-A1 CYCLOPROPANE DERIVATIVES EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-06-28 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120165339-A1 CYCLOPROPANE DERIVATIVES HCRTR2, HCRTR1, CNR1 HCRTR1 2/4885HCRTR2 1/4885KCNH2 1409/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.